7-methyl-6-methylsulfanyl-3-phenyl-purin-2-one

Systemtic Name: 7-methyl-6-methylsulfanyl-3-phenyl-purin-2-one Openeye Name: 7-methyl-6-methylsulfanyl-3-phenyl-purin-2-one CAS Name: 7-methyl-6-(methylthio)-3-phenyl-2-purinone IUPAC Name: 7-methyl-6-methylsulfanyl-3-phenylpurin-2-one Traditional Name: 7-methyl-6-(methylthio)-3-phenyl-purin-2-one Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=NC(=O)N2C3=CC=CC=C3)SC

Isomeric SMILES

CN1C=NC2=C1C(=NC(=O)N2C3=CC=CC=C3)SC

InChI

InChI=1S/C13H12N4OS/c1-16-8-14-11-10(16)12(19-2)15-13(18)17(11)9-6-4-3-5-7-9/h3-8H,1-2H3